TDT2MOL 
COc1nc(Cl)c(N)c(OC)n1
 20 20  0  0  0  0              0      
   -3.0700    0.5700    0.2700 C   0  0  0  3  0  0
   -2.7700   -0.7300    0.1000 O   0  0  0  0  0  0
   -1.3800   -0.8800   -0.0100 C   0  0  0  0  0  0
   -0.8200   -2.1500   -0.1900 N   0  0  0  0  0  0
    0.5600   -2.3000   -0.3000 C   0  0  0  0  0  0
    1.2400   -3.8400   -0.5200 Cl  0  0  0  0  0  0
    1.3900   -1.1700   -0.2300 C   0  0  0  0  0  0
    2.7800   -1.3200   -0.3400 N   0  0  0  2  0  0
    0.8400    0.1000   -0.0400 C   0  0  0  0  0  0
    1.6700    1.2200    0.0300 O   0  0  0  0  0  0
    0.9100    2.3300    0.2000 C   0  0  0  3  0  0
   -0.5500    0.2400    0.0600 N   0  0  0  0  0  0
   -4.1600    0.6900    0.3700 H   0  0  0  0  0  0
   -2.7200    1.1500   -0.6000 H   0  0  0  0  0  0
   -2.5800    0.9500    1.1800 H   0  0  0  0  0  0
    3.3700   -0.5100   -0.2900 H   0  0  0  0  0  0
    3.1800   -2.2200   -0.4600 H   0  0  0  0  0  0
    0.2300    2.4400   -0.6500 H   0  0  0  0  0  0
    0.3300    2.2300    1.1300 H   0  0  0  0  0  0
    1.5600    3.2100    0.2700 H   0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3 12  1  0
  3  4  2  0
  4  5  1  0
  5  6  1  0
  5  7  2  0
  7  8  1  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
  9 12  2  0
 13  1  1  0
 14  1  1  0
 15  1  1  0
 16  8  1  0
 17  8  1  0
 18 11  1  0
 19 11  1  0
 20 11  1  0
M  END

$$$$